CID 62416115

2260936-89-6

Structural Information

Molecular Formula

C₁₀H₁₉NO

SMILES

C1CC(C1)NCC2CCOCC2

InChI

InChI=1S/C10H19NO/c1-2-10(3-1)11-8-9-4-6-12-7-5-9/h9-11H,1-8H2

InChIKey

IFYCTEKOZLLLCV-UHFFFAOYSA-N

Compound name

N-(oxan-4-ylmethyl)cyclobutanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 169.14667 Da
Monoisotopic Mass: 1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	170.15395	132.9
[M+Na]+	192.13589	134.3
[M-H]-	168.13939	138.5
[M+NH4]+	187.18049	144.7
[M+K]+	208.10983	137.5
[M+H-H2O]+	152.14393	121.1
[M+HCOO]-	214.14487	151.4
[M+CH3COO]-	228.16052	183.8
[M+Na-2H]-	190.12134	138.8
[M]+	169.14612	136.0
[M]-	169.14722	136.0

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.